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methyl 3-(3-fluorophenyl)prop-2-ynoate
SpectraBase Compound ID 9LF0Pj0yILR
InChI InChI=1S/C10H7FO2/c1-13-10(12)6-5-8-3-2-4-9(11)7-8/h2-4,7H,1H3
InChIKey VJOULIAYOSQMCR-UHFFFAOYSA-N
Mol Weight 178.16 g/mol
Molecular Formula C10H7FO2
Exact Mass 178.043008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ygEUAQ8XFW
Name methyl 3-(3-fluorophenyl)prop-2-ynoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.043007626 u
Formula C10H7FO2
GC Column HP-5
GC Oven Program Oven temp 300oC
InChI InChI=1S/C10H7FO2/c1-13-10(12)6-5-8-3-2-4-9(11)7-8/h2-4,7H,1H3
InChIKey VJOULIAYOSQMCR-UHFFFAOYSA-N
Instrument Name GC-MS Agilent 5977B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.201800526
Molecular Weight 178.162 g/mol
Quality 162
Reported Formula C10H7FO2
SMILES COC(C#CC1=CC(=CC=C1)F)=O
SPLASH splash10-0002-0900000000-682365c6c01cea994295
Source of Spectrum QE-24-SM8-3h (DOI: 10.1002/chem.201800526)
Wiley ID 1900207